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Home > Imidazoles > 19853-01-1
19853-01-1 | 1H-Indole, 3-[(4,5-dihydro-1H-imidazol-2-yl)methyl]-
CAS No: 19853-01-1 Catalog No: AG002BLK MDL No:
Product Description
Catalog Number:
AG002BLK
Chemical Name:
1H-Indole, 3-[(4,5-dihydro-1H-imidazol-2-yl)methyl]-
CAS Number:
19853-01-1
Molecular Formula:
C12H13N3
Molecular Weight:
199.2517
IUPAC Name:
3-(4,5-dihydro-1H-imidazol-2-ylmethyl)-1H-indole
InChI:
InChI=1S/C12H13N3/c1-2-4-11-10(3-1)9(8-15-11)7-12-13-5-6-14-12/h1-4,8,15H,5-7H2,(H,13,14)
InChI Key:
HGNMPVZIINPXDA-UHFFFAOYSA-N
SMILES:
C1CN=C(N1)Cc1c[nH]c2c1cccc2
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.257g/mol
Monoisotopic Mass:
199.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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